[(2S)-4-Oxo-2-Phenyl-3,4-Dihydro-1,5-Benzothiazepin-5(2H)-Yl]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H15NO3S |
| IUPAC Name | 2-[(2s)-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid |
| Molecular Mass | 313.371 g·mol−1 |
| Heat of Formation | -332.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.89 ± 1.08 D |
| Volume | 355.09 Å 3 |
| Surface Area | 305.72 Å 2 |
| HOMO Energy | -8.86 ± 0.55 eV |
| LUMO Energy | 2.25 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FGIBWKPQWXRUBP-HNNXBMFYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |